1-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperidine-2-carboxylic acid

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperidine-2-carboxylic acid Openeye Name: 1-(4-bromo-2-chloro-phenyl)sulfonylpiperidine-2-carboxylic acid CAS Name: 1-(4-bromo-2-chlorophenyl)sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 1-(4-bromo-2-chlorophenyl)sulfonylpiperidine-2-carboxylic acid Traditional Name: 1-(4-bromo-2-chloro-phenyl)sulfonylpipecolinic acid Formula: C12H13BrClNO4S MolecularWeight: 382.65792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)S(=O)(=O)C2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

C1CCN(C(C1)C(=O)O)S(=O)(=O)C2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C12H13BrClNO4S/c13-8-4-5-11(9(14)7-8)20(18,19)15-6-2-1-3-10(15)12(16)17/h4-5,7,10H,1-3,6H2,(H,16,17)